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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Plasminogen' and Ligand = 'BDBM50292272'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Plasminogen


(Homo sapiens (Human))		BDBM50292272
PNG
(CHEMBL405963 | Cyclohexanone derivative)
Show SMILES COC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC[C@H]1CCC[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(=O)[C@@H](N)Cc2c[nH]c3ccccc23)C(=O)[C@@H](N)Cc2c[nH]c3ccccc23)C1=O)C(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)[C@@H](N)Cc1ccccc1
Show InChI InChI=1S/C68H74N12O13/c1-92-67(90)58(63(86)46(69)29-37-15-4-2-5-16-37)79-65(88)55(60(83)47(70)30-40-33-73-50-23-11-8-20-43(40)50)77-54(81)28-27-39-19-14-26-53(59(39)82)76-64(87)56(61(84)48(71)31-41-34-74-51-24-12-9-21-44(41)51)78-66(89)57(80-68(91)93-36-38-17-6-3-7-18-38)62(85)49(72)32-42-35-75-52-25-13-10-22-45(42)52/h2-13,15-18,20-25,33-35,39,46-49,53,55-58,73-75H,14,19,26-32,36,69-72H2,1H3,(H,76,87)(H,77,81)(H,78,89)(H,79,88)(H,80,91)/t39-,46+,47+,48+,49+,53-,55+,56+,57+,58+/m1/s1
PDB
MMDB

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Similars
Article
PubMed
n/an/a 3.30E+3n/an/an/an/an/an/a



Brown University

Curated by ChEMBL


Assay Description
Inhibitory concentration against plasmin

J Med Chem 48: 6908-17 (2005)


Article DOI: 10.1021/jm050488k
BindingDB Entry DOI: 10.7270/Q24M959K
More data for this
Ligand-Target Pair